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benzoic acid, 2-[[[(3,4-dihydro-5,6-dimethyl-4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)thio]acetyl]amino]-, methyl ester
SpectraBase Compound ID 9gx5qbvLZzL
InChI InChI=1S/C24H21N3O4S2/c1-14-15(2)33-21-20(14)22(29)27(16-9-5-4-6-10-16)24(26-21)32-13-19(28)25-18-12-8-7-11-17(18)23(30)31-3/h4-12H,13H2,1-3H3,(H,25,28)
InChIKey SHGIXTZUTBSIGZ-UHFFFAOYSA-N
Mol Weight 479.57 g/mol
Molecular Formula C24H21N3O4S2
Exact Mass 479.097349 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8LhzTPbkf4H
Name benzoic acid, 2-[[[(3,4-dihydro-5,6-dimethyl-4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)thio]acetyl]amino]-, methyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 479.097348512 u
Formula C24H21N3O4S2
InChI InChI=1S/C24H21N3O4S2/c1-14-15(2)33-21-20(14)22(29)27(16-9-5-4-6-10-16)24(26-21)32-13-19(28)25-18-12-8-7-11-17(18)23(30)31-3/h4-12H,13H2,1-3H3,(H,25,28)
InChIKey SHGIXTZUTBSIGZ-UHFFFAOYSA-N
Molecular Weight 479.569 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_10210
Solvent DMSO-d6
Source Vendor ID: NMR/10241498; Lab Info: LP; Lab Number: LP-2100573
Temperature 23.85 °C